Research Data Leeds Repository

Citation

Halcrow, Malcolm A. and Galadzhun, Iurii and Kulmaczewski, Rafał and Cespedes, Oscar and Yamada, Mihoko and Yoshinari, Nobuto and Konno, Takumi (2018) Data to support study of 2,6-Di(pyrazol-1-yl)pyridine-4-carboxylate Esters with Alkyl Chain Substituents, and their Iron(II) Complexes. University of Leeds. [Dataset] https://doi.org/10.5518/455

Dataset description

Two series of the title compounds have been prepared. Solid materials with longer chain substituents transform into a predominantly high-spin form when heated to ca 170 °C, which may reflect conformational changes in the alkyl chains.

Keywords:	iron; spin-crossover; isomers; chirality
Subjects:	F000 - Physical sciences > F100 - Chemistry
Divisions:	Faculty of Engineering and Physical Sciences > School of Chemistry
Related resources:	Location Type https://doi.org/10.1021/acs.inorgchem.8b02289 Publication https://eprints.whiterose.ac.uk/137202/ Publication
License:	Creative Commons Attribution 4.0 International (CC BY 4.0)
Date deposited:	18 Feb 2020 09:36
URI:	https://archive.researchdata.leeds.ac.uk/id/eprint/644
Additional details Additional details Creators or authors: Creators ORCID Other ID Email Primary affiliation Primary affiliation ID Primary affiliation ID type Secondary affiliation Secondary affiliation ID Secondary affiliation ID type Halcrow, Malcolm A. https://orcid.org/0000-0001-7491-9034 University of Leeds https://ror.org/024mrxd33 ror Galadzhun, Iurii https://orcid.org/0000-0002-0512-3830 University of Leeds https://ror.org/024mrxd33 ror Kulmaczewski, Rafał https://orcid.org/0000-0002-3855-4530 University of Leeds https://ror.org/024mrxd33 ror Cespedes, Oscar https://orcid.org/0000-0002-5249-9523 University of Leeds https://ror.org/024mrxd33 ror Yamada, Mihoko https://orcid.org/0000-0002-3789-6600 Osaka University https://ror.org/035t8zc32 ror Yoshinari, Nobuto https://orcid.org/0000-0003-2457-0967 Osaka University https://ror.org/035t8zc32 ror Konno, Takumi https://orcid.org/0000-0003-4612-5418 Osaka University https://ror.org/035t8zc32 ror Type of data: Dataset Research funders: EPSRC, University of Leeds, EPSRC, EPSRC Grant numbers: EP/K012568/1, EP/K012568/1, EP/K00512X/1 Publication date: 2018 Resource language: English Metadata language: English Research project title: Switchable molecular crystals, LIRS scholarship, Switchable molecular crystals, SQUID magnetometer Publisher: University of Leeds Contact email: m.a.halcrow@leeds.ac.uk Last Modified: 14 Oct 2024 08:57

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Documentation

compound naming and metadata [1MB] compound naming and metadata [1MB] compound naming and metadata [1MB] Security: Anyone File name: readme.pdf Content type: Documentation Mime-Type: application/pdf License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 1MB

Data

CHN microanalyses [5MB] CHN microanalyses [5MB] CHN microanalyses [5MB] Security: Anyone File name: Microanalysis.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 5MB

Single crystal X-ray diffraction [3MB] Single crystal X-ray diffraction [3MB] Single crystal X-ray diffraction [3MB] Security: Anyone File name: crystal.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 3MB

Magnetic susceptibility [2MB] Magnetic susceptibility [2MB] Magnetic susceptibility [2MB] Security: Anyone File name: magnetism.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 2MB

Evans method [12MB] Evans method [12MB] Evans method [12MB] Security: Anyone File name: Evans.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 12MB

NMR spectra [89MB] NMR spectra [89MB] NMR spectra [89MB] Security: Anyone File name: NMR.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 89MB

X-ray powder diffraction [1MB] X-ray powder diffraction [1MB] X-ray powder diffraction [1MB] Security: Anyone File name: XRPD.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 1MB

Thermogravimetric analyses [2MB] Thermogravimetric analyses [2MB] Thermogravimetric analyses [2MB] Security: Anyone File name: TGA.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 2MB

Differential Scanning Calorimetry [10MB] Differential Scanning Calorimetry [10MB] Differential Scanning Calorimetry [10MB] Security: Anyone File name: DSC.zip Content type: Data Mime-Type: application/zip License: Creative Commons Attribution 4.0 International (CC BY 4.0) File size: 10MB